SCHEMBL1551750

SCHEMBL1551750

O=C(O)c1cccc(SS)c1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
CYP1A2 P05177 1/20 0.44
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.41
HNF4A P41235 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
FOLH1 Q04609 1/20 0.41
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 1/20 0.41
RAB9A P51151 1/20 0.41
ACMSD Q8TDX5 1/20 0.40
PTPN1 P18031 3/20 0.40
PTPN2 P17706 1/20 0.40
PTPN6 P29350 1/20 0.40
KMT2A Q03164 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8890915 0.84 GAA (0.51) POLBCYP1A2GAATSHRHNF4A
SCHEMBL27488099 0.82 ALDH1A1 (0.54) TSHRHNF4ACA12CA1CA2
SCHEMBL26502 0.77 HNF4A (0.53) GAATSHRHNF4AALDH1A1ALOX15
SCHEMBL8761962 0.77 POLB (0.68) POLBCYP1A2GAACA12CA1
SCHEMBL4630736 0.76 ALDH1A1 (0.55) TSHRHNF4ACA12CA1CA2
SCHEMBL4777002 0.76 TSHR (0.59) TSHRHNF4ACA1CA2CA9
SCHEMBL5455144 0.75 ALDH1A1 (0.57) CYP1A2TSHRHNF4AALDH1A1ALOX15
SCHEMBL9717027 0.75 ALDH1A1 (0.53) TSHRHNF4ACA12CA1CA2
SCHEMBL18836973 0.75 LMNA (0.50) TSHRHNF4ACA12CA1CA2
SCHEMBL3361334 0.75 MMP2 (0.52) GAATSHRHNF4AALDH1A1ALOX15

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8544658-B2 Functionalized thin film polyamide membranes POLYMERS CRC LIMITED (AU) 2013-10-01 US disclosed
EP-2313184-B1 FUNCTIONALIZED THIN FILM POLYAMIDE MEMBRANES POLYMERS CRC LTD (AU) 2012-10-10 EP disclosed
US-20110189469-A1 FUNCTIONALIZED THIN FILM POLYAMIDE MEMBRANES POLYMERS CRC LIMITED (AU) 2011-08-04 US disclosed
EP-2313184-A1 FUNCTIONALIZED THIN FILM POLYAMIDE MEMBRANES Polymers CRC Limited (AU) 2011-04-27 EP disclosed
WO-2010015599-A1 FUNCTIONALIZED THIN FILM POLYAMIDE MEMBRANES POLYMERS CRC LIMITED (AU) 2010-02-11 WO disclosed